1,7-Dihydroxy-3-Methyl-6,11-Dioxo-6,11-Dihydro-5H-Benzo[B]Carbazole-5-Carbonitrile

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Properties Simple | Detailed

Formula C18H10N2O4
IUPAC Name 1,7-dihydroxy-3-methyl-6,11-dioxo-benzo[b]carbazol-5-ium-5a-ylium-5-carbonitrile
Molecular Mass 318.283 g·mol−1
Heat of Formation -156.2 ± 16.7 kJ·mol−1
Dipole Moment 3.97 ± 1.08 D
Volume 342.22 Å 3
Surface Area 306.26 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -1.74 ± eV
Point Group Symmetry C1
Synonyms
  • 1,7-dihydroxy-3-methyl-6,11-dioxo-5-benzo[b]carbazolecarbonitrile
  • 1,7-dihydroxy-3-methyl-6,11-dioxo-benzo[b]carbazole-5-carbonitrile
  • 1,7-dihydroxy-3-methyl-6,11-dioxobenzo[b]carbazole-5-carbonitrile
  • 1,7-dihydroxy-6,11-diketo-3-methyl-benzo[b]carbazole-5-carbonitrile
  • 5h-benzo(b)carbazole-5-carbonitrile, 6,11-dihydro-1,7-dihydroxy-3-methyl-6,11-dioxo-
  • pre-kinamycin
InChIKey ICZJRSZSGQYRIC-UHFFFAOYSA-N
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